N-[2-(3-fluoranylphenoxy)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[2-(3-fluoranylphenoxy)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[2-(3-fluorophenoxy)ethyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[2-(3-fluorophenoxy)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[2-(3-fluorophenoxy)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[2-(3-fluorophenoxy)ethyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C16H15FN4O2S2 MolecularWeight: 378.444303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)OCCNC(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)F)OCCNC(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C16H15FN4O2S2/c17-11-3-1-4-12(9-11)23-7-6-18-14(22)10-21-15(19-20-16(21)24)13-5-2-8-25-13/h1-5,8-9H,6-7,10H2,(H,18,22)(H,20,24)